3-acetamido-4-(4-methylphenyl)sulfanyl-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 3-acetamido-4-(4-methylphenyl)sulfanyl-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 3-acetamido-4-(p-tolylsulfanyl)-N-(3-pyridylmethyl)benzamide CAS Name: 3-acetamido-4-[(4-methylphenyl)thio]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 3-acetamido-4-(4-methylphenyl)sulfanyl-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 3-acetamido-4-(p-tolylthio)-N-(3-pyridylmethyl)benzamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(=O)NCC3=CN=CC=C3)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(=O)NCC3=CN=CC=C3)NC(=O)C

InChI

InChI=1S/C22H21N3O2S/c1-15-5-8-19(9-6-15)28-21-10-7-18(12-20(21)25-16(2)26)22(27)24-14-17-4-3-11-23-13-17/h3-13H,14H2,1-2H3,(H,24,27)(H,25,26)